4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride

C13H11BrClN — CID 54611204

IUPAC4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride
SMILESBrc1ccccc1/C=C\c1ccncc1.Cl
InChIInChI=1S/C13H10BrN.ClH/c14-13-4-2-1-3-12(13)6-5-11-7-9-15-10-8-11;/h1-10H;1H/b6-5-;
InChIKeyWADRNIPUWOKWND-YSMBQZINSA-N
MW296.60 g/mol
LogP4.44
Rot. Bonds2

About 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride

4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride (PubChem CID 54611204) has the molecular formula C13H11BrClN and a molecular weight of 296.60 g/mol. Its IUPAC name is 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride.

Molecular Properties

Compound Name4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride
PubChem CID54611204
Molecular FormulaC13H11BrClN
Molecular Weight296.60 g/mol
Exact Mass294.98
IUPAC Name4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride
SMILESBrc1ccccc1/C=C\c1ccncc1.Cl
InChIInChI=1S/C13H10BrN.ClH/c14-13-4-2-1-3-12(13)6-5-11-7-9-15-10-8-11;/h1-10H;1H/b6-5-;
InChIKeyWADRNIPUWOKWND-YSMBQZINSA-N
XLogP4.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.60
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-phenylethenyl)pyridine;hydrochloride
CID 71352999
4-[(E)-2-(2-bromophenyl)ethenyl]aniline
CID 89320791
4-[2-[2,4,5-tris(2-pyridin-4-ylethenyl)phenyl]ethenyl]pyridine
CID 86183195
4-[2-(2-phenylphenyl)ethenyl]pyridine
CID 141095127
4-[(E)-2-naphthalen-1-ylethenyl]pyridine
CID 5475238
1-bromo-2-[(E)-2-(3-bromophenyl)ethenyl]benzene
CID 10315048
1-[(Z)-2-(2-bromophenyl)ethenyl]-3,5-ditert-butylbenzene
CID 10714265
4-[(Z)-2-(3-bromophenyl)ethenyl]pyridine
CID 10038211
4-[(E)-2-[4-(1,2,2-triphenylethenyl)phenyl]ethenyl]pyridine
CID 102493364
2-(2-bromophenyl)ethenol
CID 174465941
(E)-1-phenyl-3-pyridin-4-ylprop-2-en-1-one
CID 5357476
2,6-bis[(E)-2-(2-bromophenyl)ethenyl]pyridine-3,5-dicarboxylic acid
CID 11763161

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride?
The IUPAC name of 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride (CID 54611204) is 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride.
What is the SMILES notation for 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride?
The canonical SMILES for 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride is Brc1ccccc1/C=C\c1ccncc1.Cl.
What is the InChIKey of 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride?
The InChIKey is WADRNIPUWOKWND-YSMBQZINSA-N. The full InChI is InChI=1S/C13H10BrN.ClH/c14-13-4-2-1-3-12(13)6-5-11-7-9-15-10-8-11;/h1-10H;1H/b6-5-;.
What are the key properties of 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride?
4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride has a molecular weight of 296.60 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-(2-bromophenyl)ethenyl]pyridine;hydrochloride is sourced from PubChem (CID 54611204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).